COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -0.011   0.249   1.840  1.00  0.00           O  
HETATM    2  C   UNL     1       0.196  -0.401   0.834  1.00  0.00           C  
HETATM    3  N   UNL     1       1.386  -0.312   0.207  1.00  0.00           N  
HETATM    4  C   UNL     1       2.430   0.568   0.738  1.00  0.00           C  
HETATM    5  C   UNL     1       3.651   0.486  -0.140  1.00  0.00           C  
HETATM    6  O   UNL     1       3.651  -0.234  -1.110  1.00  0.00           O  
HETATM    7  O   UNL     1       4.741   1.212   0.156  1.00  0.00           O  
HETATM    8  C   UNL     1       5.881   1.083  -0.734  1.00  0.00           C  
HETATM    9  C   UNL     1       7.018   1.979  -0.240  1.00  0.00           C  
HETATM   10  N   UNL     1      -0.762  -1.215   0.348  1.00  0.00           N  
HETATM   11  C   UNL     1      -0.512  -1.998  -0.865  1.00  0.00           C  
HETATM   12  C   UNL     1       0.064  -3.302  -0.497  1.00  0.00           C  
HETATM   13  C   UNL     1       0.523  -4.341  -0.203  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.053  -1.316   1.032  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.000  -0.285   0.475  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.807  -0.600  -0.603  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.676   0.342  -1.116  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.738   1.609  -0.549  1.00  0.00           C  
HETATM   19  N   UNL     1      -5.611   2.567  -1.070  1.00  0.00           N  
HETATM   20  C   UNL     1      -3.926   1.923   0.533  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.063   0.973   1.045  1.00  0.00           C  
HETATM   22  H   UNL     1       1.551  -0.830  -0.596  1.00  0.00           H  
HETATM   23  H   UNL     1       2.064   1.595   0.757  1.00  0.00           H  
HETATM   24  H   UNL     1       2.688   0.256   1.750  1.00  0.00           H  
HETATM   25  H   UNL     1       6.215   0.046  -0.747  1.00  0.00           H  
HETATM   26  H   UNL     1       5.592   1.385  -1.741  1.00  0.00           H  
HETATM   27  H   UNL     1       7.874   1.882  -0.908  1.00  0.00           H  
HETATM   28  H   UNL     1       6.683   3.017  -0.226  1.00  0.00           H  
HETATM   29  H   UNL     1       7.307   1.678   0.767  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.451  -2.152  -1.397  1.00  0.00           H  
HETATM   31  H   UNL     1       0.185  -1.461  -1.507  1.00  0.00           H  
HETATM   32  H   UNL     1       0.934  -5.272   0.059  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.469  -2.312   0.878  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.914  -1.142   2.099  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.758  -1.585  -1.043  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.306   0.095  -1.958  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.651   3.452  -0.676  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.178   2.346  -1.826  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.972   2.907   0.976  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.432   1.217   1.887  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1   10    3                                       
CONECT    3    2    4   22                                            
CONECT    4    5    3   23   24                                       
CONECT    5    6    6    7    4                                       
CONECT    6    5    5                                                 
CONECT    7    8    5                                                 
CONECT    8    9    7   25   26                                       
CONECT    9    8   27   28   29                                       
CONECT   10   14    2   11                                            
CONECT   11   10   12   30   31                                       
CONECT   12   11   13   13   13                                       
CONECT   13   12   12   12   32                                       
CONECT   14   15   10   33   34                                       
CONECT   15   21   21   16   14                                       
CONECT   16   17   17   15   35                                       
CONECT   17   18   16   16   36                                       
CONECT   18   19   20   20   17                                       
CONECT   19   18   37   38                                            
CONECT   20   18   18   21   39                                       
CONECT   21   20   15   15   40                                       
CONECT   22    3                                                      
CONECT   23    4                                                      
CONECT   24    4                                                      
CONECT   25    8                                                      
CONECT   26    8                                                      
CONECT   27    9                                                      
CONECT   28    9                                                      
CONECT   29    9                                                      
CONECT   30   11                                                      
CONECT   31   11                                                      
CONECT   32   13                                                      
CONECT   33   14                                                      
CONECT   34   14                                                      
CONECT   35   16                                                      
CONECT   36   17                                                      
CONECT   37   19                                                      
CONECT   38   19                                                      
CONECT   39   20                                                      
CONECT   40   21                                                      
MASTER        0    0    0    0    0    0    0    0   40    0   40    0
END
